5-{[(5-bromo-2-hydroxyphenyl)methyl]amino}-1H-pyrazole-4-carbonitrile
Chemical Structure Depiction of
5-{[(5-bromo-2-hydroxyphenyl)methyl]amino}-1H-pyrazole-4-carbonitrile
5-{[(5-bromo-2-hydroxyphenyl)methyl]amino}-1H-pyrazole-4-carbonitrile
Compound characteristics
| Compound ID: | 8017-1999 |
| Compound Name: | 5-{[(5-bromo-2-hydroxyphenyl)methyl]amino}-1H-pyrazole-4-carbonitrile |
| Molecular Weight: | 293.12 |
| Molecular Formula: | C11 H9 Br N4 O |
| Smiles: | C(c1cc(ccc1O)[Br])Nc1c(C#N)cn[nH]1 |
| Stereo: | ACHIRAL |
| logP: | 1.742 |
| logD: | 1.7414 |
| logSw: | -1.9304 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 68.408 |
| InChI Key: | HJRFKMDEPFWTNN-UHFFFAOYSA-N |